Geometry & MOs

Info

ID:	214558
PubChem CID:	85083189
Reduced:	O7C32H52 (1)
Stoich.:	A7B32C52 (1)
Weight, g/mol:	548.335328
ΔH_f, kcal/mol:	-403.95
Dipole, Da:	5.93
IP(EA), eV:	-9.51(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[tert-butyl(dimethyl)silyl] 6-[4-[2-[tert-butyl(dimethyl)silyl]oxyphenyl]-2,2-dimethyl-1,3-dioxan-5-yl]hex-4-enoate

Drug info:

PubChemData

Smile

CC(CCC(=O)OC)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)OC(=O)C)COC(=O)C(C)(C)C)O)C

DOS

IR

Vibrations